9FSH
Crystal structure of the HECT domain of Smurf 2 in complex with inhibitor 8
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SLS BEAMLINE X10SA |
| Synchrotron site | SLS |
| Beamline | X10SA |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2010-03-13 |
| Detector | DECTRIS PILATUS 6M-F |
| Wavelength(s) | 1.00000 |
| Spacegroup name | P 21 21 21 |
| Unit cell lengths | 52.531, 71.750, 152.624 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 43.270 - 2.080 |
| R-factor | 0.2302 |
| Rwork | 0.229 |
| R-free | 0.25900 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 1WAPI |
| RMSD bond length | 0.008 |
| RMSD bond angle | 0.850 |
| Data reduction software | XDS |
| Data scaling software | XSCALE |
| Phasing software | MOLREP |
| Refinement software | BUSTER (2.11.8) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 76.310 | 2.150 |
| High resolution limit [Å] | 2.080 | 2.080 |
| Rmerge | 0.080 | 0.499 |
| Number of reflections | 35457 | 675 |
| <I/σ(I)> | 17.68 | 3.72 |
| Completeness [%] | 99.9 | 99.9 |
| Redundancy | 6.33 | 6.51 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 293 | 1.5 M NaH2PO4/K2HPO4 pH 6.8, 100 mM NaOAc |
